2-[7-(dimethylamino)-6-oxidanyl-5-phenoxy-heptyl]benzenecarbonitrile

Systemtic Name: 2-[7-(dimethylamino)-6-oxidanyl-5-phenoxy-heptyl]benzenecarbonitrile Openeye Name: 2-[7-(dimethylamino)-6-hydroxy-5-phenoxy-heptyl]benzonitrile CAS Name: 2-[7-(dimethylamino)-6-hydroxy-5-phenoxyheptyl]benzonitrile IUPAC Name: 2-[7-(dimethylamino)-6-hydroxy-5-phenoxyheptyl]benzonitrile Traditional Name: 2-[7-(dimethylamino)-6-hydroxy-5-phenoxy-heptyl]benzonitrile Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(C(CCCCC1=CC=CC=C1C#N)OC2=CC=CC=C2)O

Isomeric SMILES

CN(C)CC(C(CCCCC1=CC=CC=C1C#N)OC2=CC=CC=C2)O

InChI

InChI=1S/C22H28N2O2/c1-24(2)17-21(25)22(26-20-13-4-3-5-14-20)15-9-8-11-18-10-6-7-12-19(18)16-23/h3-7,10,12-14,21-22,25H,8-9,11,15,17H2,1-2H3